5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine

C8H15N3OS — CID 89006318

IUPAC5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine
SMILESCCN(CCOC)c1cnc(N)s1
InChIInChI=1S/C8H15N3OS/c1-3-11(4-5-12-2)7-6-10-8(9)13-7/h6H,3-5H2,1-2H3,(H2,9,10)
InChIKeyNXVOQDCUMMIHSQ-UHFFFAOYSA-N
MW201.29 g/mol
LogP1.20
Rot. Bonds5

About 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine

5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine (PubChem CID 89006318) has the molecular formula C8H15N3OS and a molecular weight of 201.29 g/mol. Its IUPAC name is 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine
PubChem CID89006318
Molecular FormulaC8H15N3OS
Molecular Weight201.29 g/mol
Exact Mass201.09
IUPAC Name5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine
SMILESCCN(CCOC)c1cnc(N)s1
InChIInChI=1S/C8H15N3OS/c1-3-11(4-5-12-2)7-6-10-8(9)13-7/h6H,3-5H2,1-2H3,(H2,9,10)
InChIKeyNXVOQDCUMMIHSQ-UHFFFAOYSA-N
XLogP1.20
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine?
The IUPAC name of 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine (CID 89006318) is 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine?
The canonical SMILES for 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine is CCN(CCOC)c1cnc(N)s1.
What is the InChIKey of 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine?
The InChIKey is NXVOQDCUMMIHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3OS/c1-3-11(4-5-12-2)7-6-10-8(9)13-7/h6H,3-5H2,1-2H3,(H2,9,10).
What are the key properties of 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine?
5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine has a molecular weight of 201.29 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-ethyl-5-N-(2-methoxyethyl)-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 89006318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).